ethyl 4-(4-ethoxyphenyl)-2-phenyl-4,10-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate

Systemtic Name: ethyl 4-(4-ethoxyphenyl)-2-phenyl-4,10-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate Openeye Name: ethyl 4-(4-ethoxyphenyl)-2-phenyl-4,10-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate CAS Name: 4-(4-ethoxyphenyl)-2-phenyl-4,10-dihydropyrimido[1,2-a]benzimidazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-ethoxyphenyl)-2-phenyl-4,10-dihydropyrimido[1,2-a]benzimidazole-3-carboxylate Traditional Name: 2-phenyl-4-p-phenetyl-4,10-dihydropyrimido[1,2-a]benzimidazole-3-carboxylic acid ethyl ester Formula: C27H25N3O3 MolecularWeight: 439.5057

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2C(=C(N=C3N2C4=CC=CC=C4N3)C5=CC=CC=C5)C(=O)OCC

Isomeric SMILES

CCOC1=CC=C(C=C1)C2C(=C(N=C3N2C4=CC=CC=C4N3)C5=CC=CC=C5)C(=O)OCC

InChI

InChI=1S/C27H25N3O3/c1-3-32-20-16-14-19(15-17-20)25-23(26(31)33-4-2)24(18-10-6-5-7-11-18)29-27-28-21-12-8-9-13-22(21)30(25)27/h5-17,25H,3-4H2,1-2H3,(H,28,29)